%chk=000115154.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000115154

0 1
 O   -5.650200     -0.1378000       1.728600    
 O   -4.799500      0.7863000      -2.029900    
 O   0.7134000      -2.414800      -2.363100    
 O    4.706100       4.217600      -1.017100    
 O    3.765700       2.266100      -1.692200    
 C   -3.547100      0.4302000      0.6688000    
 C   -2.929300      3.8199998E-02 -0.6858000    
 C   -4.610100     -0.6455000      0.9097000    
 C   -4.170300     -0.3750000      -1.490000    
 C   -5.130400      -1.023200     -0.4837000    
 C   -2.565200      0.5735000       1.825300    
 C   -1.931400      -1.079300     -0.6370000    
 C   -1.494800       1.619100       1.679600    
 C  -0.6683000     -0.9718000      -1.074300    
 C   0.3285000      -2.095600      -1.024500    
 C  -0.1670000       1.434500       1.735600    
 C    1.604200      -1.728600     -0.2542000    
 C    2.590700      -2.893400     -0.1295000    
 C   0.8339000       2.540300       1.567400    
 C    3.829200      -2.553700      0.7061000    
 C    1.787000       2.334100      0.3820000    
 C    4.849200      -3.690900      0.7742000    
 C    2.824400       3.448900      0.2171000    
 C    6.052000      -3.306500       1.622700    
 C    3.779300       3.227500     -0.9357000    
 H   -4.055700       1.399600      0.5521000    
 H   -2.470600      0.9286000      -1.135600    
 H   -4.184100      -1.525200       1.406600    
 H   -3.939700      -1.042400      -2.327500    
 H   -5.088200      -2.114000     -0.5867000    
 H   -6.170300     -0.7140000     -0.6353000    
 H   -2.099700     -0.3960000       2.045400    
 H   -3.135200      0.8285000       2.728900    
 H   -2.260600      -2.028300     -0.2197000    
 H   -6.326100     -0.8326000       1.805000    
 H   -5.585100      0.4906000      -2.521000    
 H   -1.864800       2.628400       1.506800    
 H  -0.3281000     -2.9999999E-02  -1.498400    
 H  -0.1157000      -2.996400     -0.5846000    
 H   0.2229000      0.4375000       1.919500    
 H    1.335300      -1.384700      0.7516000    
 H    2.114100     -0.8971000     -0.7581000    
 H    2.912300      -3.207400      -1.130000    
 H    2.081500      -3.752900      0.3236000    
 H    1.421600       2.608300       2.491100    
 H   0.3259000       3.505700       1.451400    
 H    3.512100      -2.287800       1.722200    
 H    4.311800      -1.663600      0.2832000    
 H  -8.6300001E-02  -2.695200      -2.840800    
 H    1.202600       2.246900     -0.5435000    
 H    2.310000       1.376300      0.5020000    
 H    4.378900      -4.585700       1.197700    
 H    5.186500      -3.948000     -0.2366000    
 H    3.419100       3.526700       1.134200    
 H    2.310100       4.401800      4.9199998E-02
 H    6.561800      -2.431500       1.207100    
 H    5.750000      -3.073700       2.648900    
 H    6.769400      -4.132300       1.658700    
 H    5.338300       4.066800      -1.752000    


%chk=000115154-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000115154

0 1
O -5.751764 -0.003807 1.774631
O -4.885771 0.812814 -2.053464
O 0.689509 -2.605335 -2.387233
O 5.015152 3.717404 -0.832206
O 4.414393 1.482704 -0.664198
C -3.644238 0.427608 0.625464
C -3.043384 -0.022214 -0.746244
C -4.726573 -0.634818 0.926221
C -4.320923 -0.447259 -1.526575
C -5.250625 -1.110335 -0.466213
C -2.655921 0.639936 1.793305
C -2.039758 -1.152688 -0.647038
C -1.646731 1.743101 1.546593
C -0.768560 -1.083253 -1.122151
C 0.256235 -2.189525 -1.024386
C -0.308037 1.615435 1.736689
C 1.535290 -1.739581 -0.294931
C 2.606494 -2.844044 -0.175907
C 0.735847 2.686292 1.497660
C 3.882787 -2.346418 0.540098
C 1.865779 2.182295 0.562887
C 4.983670 -3.427004 0.635044
C 2.976869 3.228796 0.358972
C 6.248742 -2.935951 1.371831
C 4.162154 2.682117 -0.413534
H -4.190198 1.373397 0.434572
H -2.574445 0.828374 -1.271305
H -4.277003 -1.491669 1.475956
H -4.089984 -1.131372 -2.368543
H -5.225744 -2.212477 -0.554182
H -6.297320 -0.779195 -0.601793
H -2.119818 -0.305143 2.012206
H -3.267478 0.880317 2.688182
H -2.366810 -2.082630 -0.151226
H -6.360369 -0.700490 2.128049
H -5.764675 0.624059 -2.469289
H -2.051995 2.706298 1.194750
H -0.421760 -0.164300 -1.619494
H -0.188078 -3.064930 -0.497642
H 0.081753 0.642958 2.081684
H 1.245858 -1.382687 0.714497
H 1.960883 -0.872036 -0.836750
H 2.857641 -3.206042 -1.190519
H 2.187023 -3.711830 0.376733
H 1.191393 2.989457 2.465750
H 0.259740 3.592507 1.073445
H 3.622234 -2.002444 1.564286
H 4.281156 -1.457935 0.008002
H -0.123177 -2.745221 -2.937457
H 1.435227 1.897839 -0.415885
H 2.310854 1.259900 0.981235
H 4.576214 -4.320335 1.152284
H 5.255157 -3.757608 -0.388177
H 3.359021 3.584331 1.338316
H 2.604284 4.130174 -0.162261
H 6.688822 -2.060084 0.858653
H 6.009361 -2.629579 2.408101
H 7.022837 -3.724256 1.422305
H 5.792759 3.323487 -1.314298


